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Theoretical core spectroscopy of molecules interacting with ice surfaces
SolvATE2020: Scientific Meeting of the GdR SolvATE, Online, 25-11-2020, 25-11-2020Communication dans un congrès avec actes -
Challenges in relativistic electronic structure calculations of gas-phase reactivity and thermodynamics of actinide species
Plutonium Futures 2020, Montpellier, 07-06-2020, 07-06-2020Communication dans un congrès avec actes -
Synthesis and Photoluminescence of Three Bismuth(III)-Organic Compounds Bearing Heterocyclic N-Donor Ligands
Dalton Transactions, Royal Society of Chemistry, 07-08-2020, 49, 11756--11771Compte-rendu et recension critique d'ouvragetexte intégral -
Determining core electron binding energies with four-component based EOM-CCSD approaches
Torun's Astrochemistry, theoretical Spectroscopy and Quantum chemistry group Minisymposium, Torún, 30-10-2020, 30-10-2020 -
Activation of Actinyls to Generate Actinide Nitridos, which Activate CO<sub>2</sub> to Regenerate the Actinyls
Inorganic Chemistry Gordon Research Conference, Newport, Ri, 31-05-2020, 31-05-2020Autre communication scientifique (congrès sans actes - poster - séminaire...) -
Development of Theoretical Tools for Modeling Core and Valence Spectroscopies and their Applications to Species of Atmospheric Interest
JTMS 2020 : Journées "Théorie, Modélisation et Simulation", Visioconférence, 02-11-2020, 02-11-2020Autre communication scientifique (congrès sans actes - poster - séminaire...) -
Exploration of the Core Valence Separation approximation to obtain the ionization potentials of the core electrons by the EOM-CCSD method according to a 4-component relativistic approach
Première réunion générale du GDR NBODY : Problème Quantique à N Corps en Chimie et Physique, Lille, 08-01-2020, 08-01-2020Autre communication scientifique (congrès sans actes - poster - séminaire...) -
Conformational Landscape of Oxygen-Containing Naphthalene Derivatives
Journal of Physical Chemistry A, American Chemical Society, 14-05-2020, 124, 4484-4495Compte-rendu et recension critique d'ouvragetexte intégral -
The electronic excited states of dichloromethane in the 5.8-10.8 eV energy range investigated by experimental and theoretical methods
Journal of Quantitative Spectroscopy and Radiative Transfer, Elsevier, 17-06-2020, 253, 107172Compte-rendu et recension critique d'ouvragetexte intégral -
Cover Image, Volume 120, Issue 21
International Journal of Quantum Chemistry, Wiley, 01-11-2020, 120; 21Compte-rendu et recension critique d'ouvrage